5-azanyl-1-(6-phenoxy-2-phenyl-pyrimidin-4-yl)pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(6-phenoxy-2-phenyl-pyrimidin-4-yl)pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(6-phenoxy-2-phenyl-pyrimidin-4-yl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-(6-phenoxy-2-phenyl-4-pyrimidinyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(6-phenoxy-2-phenylpyrimidin-4-yl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-(6-phenoxy-2-phenyl-pyrimidin-4-yl)pyrazole-4-carbonitrile Formula: C20H14N6O MolecularWeight: 354.36476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CC(=N2)OC3=CC=CC=C3)N4C(=C(C=N4)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CC(=N2)OC3=CC=CC=C3)N4C(=C(C=N4)C#N)N

InChI

InChI=1S/C20H14N6O/c21-12-15-13-23-26(19(15)22)17-11-18(27-16-9-5-2-6-10-16)25-20(24-17)14-7-3-1-4-8-14/h1-11,13H,22H2